0 mol 11 unq 0 iso 0 dist 5.95165 9.80646 6.84216 6.50001 4.10106 9.89425 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7522 3.30063 7.98005 9.90986 7.11305 8.97754 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.10899 12.1168 9.99939 12.265 7.7766 7.34832 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.77553 12.4324 9.45756 14.3019 12.3186 5.4713 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 4.88613 6.09663 7.17488 11.0988 10.0669 9.10675 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.06168 15.6688 8.62079 13.7119 5.9144 4.27766 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.67532 8.22845 8.62079 9.762 5.9144 4.27766 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 9.73174 6.88119 9.10911 11.7099 8.4494 9.25023 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 9.65418 9.95216 9.10911 14.3277 8.4494 9.25023 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 7.91337 3.80816 4.80684 5.90003 6.30721 4.55071 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.40546 3.80816 7.60162 5.90003 10.5082 4.55071 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 8.67193 12.0363 8.111 10.119 4.1335 4.14492 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.80299 5.18174 9.65093 12.9953 11.6282 9.4366 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 9.55777 9.08651 5.1609 15.2698 6.84862 8.88902 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 8.91612 9.82989 8.94786 15.6281 10.1605 9.454 numMergedOcc 0
15 mol 256 unq 0 iso 0 dist 7.67598 8.46364 4.80903 13.1814 6.30188 7.32564 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 8.59986 9.9168 8.97531 6.22195 4.74189 9.83672 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.96343 7.9169 7.42932 10.3461 4.40029 5.13533 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 9.29635 7.31817 4.9764 11.7453 3.97543 5.13533 numMergedOcc 0
